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root/group/trunk/OOPSE/libBASS/Globals.hpp
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Comparing trunk/OOPSE/libBASS/Globals.hpp (file contents):
Revision 378 by mmeineke, Fri Mar 21 17:42:12 2003 UTC vs.
Revision 394 by gezelter, Mon Mar 24 21:55:34 2003 UTC

# Line 42 | Line 42 | class Globals{ (public)
42    double getStatusTime( void )      { return status_time; }
43    double getThermalTime( void )     { return thermal_time; }
44    double getDielectric( void )      { return dielectric; }
45 <  double getRRF( void)              { return rRF; }
45 >  double getECR( void)              { return ecr; }
46 >  double getEST( void)              { return est; }
47    int    getTempSet( void )         { return tempSet; }
48    int    getPBC( void )             { return usePBC;}
49 +  int    getUseRF( void )           { return useRF;}
50    char*  getMixingRule( void)       { return mixingRule;}
51    
52    short int haveInitialConfig( void ) { return have_initial_config; }
# Line 58 | Line 60 | class Globals{ (public)
60    short int haveSampleTime( void )    { return have_sample_time; }
61    short int haveStatusTime( void )    { return have_status_time; }
62    short int haveThermalTime( void )   { return have_thermal_time; }
63 <  short int haveRRF( void )           { return have_rrf; }
63 >  short int haveECR( void )           { return have_ecr; }
64 >  short int haveEST( void )           { return have_est; }
65    short int haveDielectric( void )    { return have_dielectric; }
66    short int haveTempSet( void )       { return have_tempSet; }
67    
# Line 93 | Line 96 | class Globals{ (public)
96    double sample_time;
97    double status_time;
98    double thermal_time;
99 <  double rRF;
99 >  double ecr;
100 >  double est;
101    double dielectric;
102    int tempSet;
103    int usePBC;
104 +  int useRF;
105  
106    //required arguments
107    short int have_force_field, have_n_components, have_target_temp;
# Line 105 | Line 110 | class Globals{ (public)
110    // optional arguments
111    short int have_initial_config, have_final_config, have_n_mol;
112    short int have_density, have_box, have_box_x, have_box_y, have_box_z;
113 <  short int have_sample_time, have_status_time, have_rrf, have_dielectric;
114 <  short int have_tempSet, have_thermal_time;
113 >  short int have_sample_time, have_status_time, have_ecr, have_dielectric;
114 >  short int have_tempSet, have_thermal_time, have_est;
115    
116  
117   };

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